6-(4-methoxy-4-oxidanylidene-but-2-ynoxy)-4,7-bis(oxidanylidene)-1H-cyclohepta[b]pyridine-2-carboxylic acid

Systemtic Name: 6-(4-methoxy-4-oxidanylidene-but-2-ynoxy)-4,7-bis(oxidanylidene)-1H-cyclohepta[b]pyridine-2-carboxylic acid Openeye Name: 6-(4-methoxy-4-oxo-but-2-ynoxy)-4,7-dioxo-1H-cyclohepta[b]pyridine-2-carboxylic acid CAS Name: 6-(4-methoxy-4-oxobut-2-ynoxy)-4,7-dioxo-1H-cyclohepta[b]pyridine-2-carboxylic acid IUPAC Name: 6-(4-methoxy-4-oxobut-2-ynoxy)-4,7-dioxo-1H-cyclohepta[b]pyridine-2-carboxylic acid Traditional Name: 4,7-diketo-6-(4-keto-4-methoxy-but-2-ynoxy)-1H-cyclohepta[b]pyridine-2-carboxylic acid Formula: C16H11NO7 MolecularWeight: 329.26104

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCOC1=CC2=C(C=CC1=O)NC(=CC2=O)C(=O)O

Isomeric SMILES

COC(=O)C#CCOC1=CC2=C(C=CC1=O)NC(=CC2=O)C(=O)O

InChI

InChI=1S/C16H11NO7/c1-23-15(20)3-2-6-24-14-7-9-10(4-5-12(14)18)17-11(16(21)22)8-13(9)19/h4-5,7-8H,6H2,1H3,(H,17,19)(H,21,22)